7-amino-N-(1-methylpiperidin-4-yl)heptanamide

C13H27N3O — CID 43373568

IUPAC7-amino-N-(1-methylpiperidin-4-yl)heptanamide
SMILESCN1CCC(NC(=O)CCCCCCN)CC1
InChIInChI=1S/C13H27N3O/c1-16-10-7-12(8-11-16)15-13(17)6-4-2-3-5-9-14/h12H,2-11,14H2,1H3,(H,15,17)
InChIKeyGUTXYIUENFHDBO-UHFFFAOYSA-N
MW241.38 g/mol
LogP1.11
Rot. Bonds7

About 7-amino-N-(1-methylpiperidin-4-yl)heptanamide

7-amino-N-(1-methylpiperidin-4-yl)heptanamide (PubChem CID 43373568) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 7-amino-N-(1-methylpiperidin-4-yl)heptanamide.

Molecular Properties

Compound Name7-amino-N-(1-methylpiperidin-4-yl)heptanamide
PubChem CID43373568
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name7-amino-N-(1-methylpiperidin-4-yl)heptanamide
SMILESCN1CCC(NC(=O)CCCCCCN)CC1
InChIInChI=1S/C13H27N3O/c1-16-10-7-12(8-11-16)15-13(17)6-4-2-3-5-9-14/h12H,2-11,14H2,1H3,(H,15,17)
InChIKeyGUTXYIUENFHDBO-UHFFFAOYSA-N
XLogP1.11
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-amino-N-(1-propylpiperidin-4-yl)hexanamide
CID 61276354
bis[5-[(1-methylpiperidin-4-yl)amino]-5-oxopentyl] oxalate
CID 57039386
7-amino-N-(1-prop-2-enylpiperidin-4-yl)heptanamide
CID 119879080
3-(7-aminoheptanoylamino)-N-ethylpyrrolidine-1-carboxamide
CID 119820641
3-amino-N-(1-methylpyrrolidin-3-yl)propanamide
CID 61465444
N-(1-methylpyrrolidin-3-yl)-12-oxotridecanamide
CID 169229027
4-(7-aminoheptanoylamino)cyclohexane-1-carboxylic acid
CID 61160664
4-amino-N-(1-cyclopropylpiperidin-4-yl)butanamide
CID 43711759
6-amino-N-(4-methylcycloheptyl)hexanamide
CID 114100037
N,N'-dicyclopropyldecanediamide
CID 4668836
7-amino-N-(1,1-dioxothiolan-3-yl)heptanamide
CID 24710783
3-(1-aminocyclopropyl)-N-(1-methylpiperidin-4-yl)propanamide
CID 115035177

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-(1-methylpiperidin-4-yl)heptanamide?
The IUPAC name of 7-amino-N-(1-methylpiperidin-4-yl)heptanamide (CID 43373568) is 7-amino-N-(1-methylpiperidin-4-yl)heptanamide.
What is the SMILES notation for 7-amino-N-(1-methylpiperidin-4-yl)heptanamide?
The canonical SMILES for 7-amino-N-(1-methylpiperidin-4-yl)heptanamide is CN1CCC(NC(=O)CCCCCCN)CC1.
What is the InChIKey of 7-amino-N-(1-methylpiperidin-4-yl)heptanamide?
The InChIKey is GUTXYIUENFHDBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-16-10-7-12(8-11-16)15-13(17)6-4-2-3-5-9-14/h12H,2-11,14H2,1H3,(H,15,17).
What are the key properties of 7-amino-N-(1-methylpiperidin-4-yl)heptanamide?
7-amino-N-(1-methylpiperidin-4-yl)heptanamide has a molecular weight of 241.38 g/mol, XLogP of 1.11, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-(1-methylpiperidin-4-yl)heptanamide is sourced from PubChem (CID 43373568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).